Graph Regression on Materials Project 2021.05 (test)
0.028Energy (eV/atom)MEGNET
Evaluation results
| Method | Links | ||||
|---|---|---|---|---|---|
| MEGNETImplementation setup=Original2022.11 | 0.028 | — | — | 0.33 | |
| CGCNNImplementation setup=Original2022.11 | 0.039 | 0.363 | — | 0.388 | |
| SCHNETImplementation setup=Original2022.11 | 0.041 | — | — | — | |
| ECN-SΛImplementation setup=Ours2022.11 | 0.046 | 0.281 | 0.106 | 0.39 | |
| CGCNNImplementation setup=Ours (re-trained)2022.11 | 0.048 | 0.307 | 0.111 | 0.399 | |
| ECN-P¯1Implementation setup=Ours2022.11 | 0.052 | 0.303 | 0.108 | 0.44 | |
| MEGNETImplementation setup=Ours (re-trained)2022.11 | 0.056 | 0.365 | 0.11 | 0.434 |